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2-PROPENOIC ACID, 3-(5-ACETYL-2,2-DIMETHYLCYCLOPENTYL)-, METHYL ESTER, [1alpha(E),5alpha]-
SpectraBase Compound ID 6Onv2lMMKEP
InChI InChI=1S/C13H20O3/c1-9(14)10-7-8-13(2,3)11(10)5-6-12(15)16-4/h5-6,10-11H,7-8H2,1-4H3/b6-5+
InChIKey KNZZSJMNFJGPOE-AATRIKPKSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nshmovPAgW
Name Methyl (2E)-3-(5-acetyl-2,2-dimethylcyclopentyl)-2-propenoate
CAS Registry Number 77383-94-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-9(14)10-7-8-13(2,3)11(10)5-6-12(15)16-4/h5-6,10-11H,7-8H2,1-4H3/b6-5+
InChIKey KNZZSJMNFJGPOE-AATRIKPKSA-N
Molecular Weight 224.300 g/mol
SMILES CC1(C(C(CC1)C(=O)C)\C=C\C(=O)OC)C
SPLASH splash10-006x-9800000000-a51e5146ddde9cd4f3f1
Synonyms (E)-3-(5-acetyl-2,2-dimethyl-cyclopentyl)acrylic acid methyl ester (E)-3-(5-acetyl-2,2-dimethylcyclopentyl)-2-propenoic acid methyl ester 2-Propenoic acid, 3-(5-acetyl-2,2-dimethylcyclopentyl)-, methyl ester, [1.alpha.(E),5.alpha.]- Methyl (E)-3-(5-acetyl-2,2-dimethyl-cyclopentyl)prop-2-enoate Methyl (E)-3-(5-ethanoyl-2,2-dimethyl-cyclopentyl)prop-2-enoate
Wiley ID 1488065